SCHEMBL1800528

SCHEMBL1800528

CCCC(C)C(=O)N1CCC2(CC1)NC(CC(C)C)C(=O)N2C(CC)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADAMTS5 Q9UNA0 5/20 0.34
ADAM17 P78536 3/20 0.34
MMP2 P08253 1/20 0.34
USP19 O94966 3/20 0.33
MME P08473 1/20 0.32
CCR5 P51681 5/20 0.31
ACE P12821 1/20 0.30
ADAMTS4 O75173 1/20 0.30
EP300 Q09472 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1799979 0.85 CYP3A4 (0.40) MME
SCHEMBL1799769 0.83 CYP3A4 (0.36) USP19MMECCR5
SCHEMBL1797694 0.82 CCR5 (0.33) ADAMTS5ADAM17MMP2CCR5
SCHEMBL1798461 0.78 CYP2D6 (0.48)
SCHEMBL1800700 0.73 CYP3A4 (0.37)
SCHEMBL1800968 0.73 CYP3A4 (0.41)
SCHEMBL4285003 0.72 MMP2 (0.33) ADAMTS5ADAM17MMP2USP19
SCHEMBL1803789 0.72 CHRM2 (0.45)
SCHEMBL1798796 0.70 KMT2A (0.37) USP19
SCHEMBL1801126 0.69 CCR5 (0.37) ADAMTS5ADAM17MMP2CCR5

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070015784-A1 Subsitituted 1,4,8- triazaspiro [4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2007-01-18 US claimed
US-7951815-B2 Substituted 1,4,8-triazaspiro [4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2011-05-31 US disclosed
US-20070015784-A1 Subsitituted 1,4,8- triazaspiro [4,5]decan-2-one compounds GRUENENTHAL GMBH (DE) 2007-01-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070015784-A1 Subsitituted 1,4,8- triazaspiro [4,5]decan-2-one compounds SI, SSTR4, SLC10A2 ADAMTS5 251/4885ADAM17 2712/4885MMP2 1705/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.